(6R,7R)-7-[2-[2-[(E)-hydroxyiminomethyl]phenoxy]ethanoylamino]-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: (6R,7R)-7-[2-[2-[(E)-hydroxyiminomethyl]phenoxy]ethanoylamino]-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: (6R,7R)-7-[[2-[2-[(E)-hydroxyiminomethyl]phenoxy]acetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: (6R,7R)-7-[[2-[2-[(E)-hydroxyiminomethyl]phenoxy]-1-oxoethyl]amino]-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: (6R,7R)-7-[[2-[2-[(E)-hydroxyiminomethyl]phenoxy]acetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: (6R,7R)-7-[[2-[2-[(E)-hydroximinomethyl]phenoxy]acetyl]amino]-8-keto-3-[[(1-methyltetrazol-5-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C19H19N7O6S2 MolecularWeight: 505.52746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)COC4=CC=CC=C4C=NO)SC2)C(=O)O

Isomeric SMILES

CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)COC4=CC=CC=C4/C=N/O)SC2)C(=O)O

InChI

InChI=1S/C19H19N7O6S2/c1-25-19(22-23-24-25)34-9-11-8-33-17-14(16(28)26(17)15(11)18(29)30)21-13(27)7-32-12-5-3-2-4-10(12)6-20-31/h2-6,14,17,31H,7-9H2,1H3,(H,21,27)(H,29,30)/b20-6+/t14-,17-/m1/s1